CID 15625665

(+)-2-sterpurene-6-ol

Structural Information

Molecular Formula
C15H24O
SMILES
CC1=C2CC(C[C@H]2C[C@]3([C@@]1(CC3)O)C)(C)C
InChI
InChI=1S/C15H24O/c1-10-12-9-13(2,3)7-11(12)8-14(4)5-6-15(10,14)16/h11,16H,5-9H2,1-4H3/t11-,14-,15-/m0/s1
InChIKey
BFLPKQMMVQBPAM-CQDKDKBSSA-N
Compound name
(3R,6S,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.03,6]undec-1-en-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.18271 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.18999 153.8
[M+Na]+ 243.17193 161.9
[M-H]- 219.17543 158.5
[M+NH4]+ 238.21653 175.5
[M+K]+ 259.14587 160.0
[M+H-H2O]+ 203.17997 147.2
[M+HCOO]- 265.18091 169.4
[M+CH3COO]- 279.19656 192.8
[M+Na-2H]- 241.15738 158.2
[M]+ 220.18216 161.3
[M]- 220.18326 161.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.